SCHEMBL5308455

SCHEMBL5308455

COC(=O)Cn1c(C)c(N)c2cc(Cl)ccc21

nearest known ligand 0.48

Predicted protein targets (top 17)

geneUniProtsupporting neighboursconfidence
MAPT P10636 5/20 0.48
PTGDR2 Q9Y5Y4 8/20 0.47
HSD17B10 Q99714 2/20 0.44
ALDH1A1 P00352 4/20 0.43
CA12 O43570 1/20 0.41
CA1 P00915 1/20 0.41
CA2 P00918 1/20 0.41
CA9 Q16790 1/20 0.41
LMNA P02545 1/20 0.41
HK1 P19367 1/20 0.41
HKDC1 Q2TB90 1/20 0.41
KDM4E B2RXH2 2/20 0.41
SMN1; SMN2 Q16637 2/20 0.41
HPGD P15428 1/20 0.41
PLA2G2A P14555 2/20 0.41
GAA P10253 1/20 0.41
CYP2C9 P11712 1/20 0.40

Click a target to see other patent compounds predicted against it — the reverse direction, in place.

Similar compounds — the chemically nearest patent molecules

Nearest neighbours by Morgan-fingerprint cosine across the patent-compound collection, with each neighbour's top predicted target and the predicted targets it shares with this molecule.

Compoundsimilaritytop predictedshared targets
Hydrochloric Acid SCHEMBL5308453 0.99 MAPT (0.47) MAPTPTGDR2HSD17B10ALDH1A1CA12
SCHEMBL1757609 0.84 MAPT (0.48) MAPTPTGDR2HSD17B10ALDH1A1LMNA
SCHEMBL5310459 0.80 MAPT (0.45) MAPTPTGDR2HSD17B10ALDH1A1CA12
SCHEMBL5314252 0.78 PTGDR2 (0.47) MAPTPTGDR2ALDH1A1CA12CA1
SCHEMBL5310070 0.77 CA12 (0.43) MAPTPTGDR2HSD17B10ALDH1A1CA12
SCHEMBL1758023 0.77 PTGDR2 (0.49) MAPTPTGDR2HSD17B10ALDH1A1LMNA
SCHEMBL1757624 0.76 PTGDR2 (0.51) MAPTPTGDR2HSD17B10ALDH1A1LMNA
SCHEMBL5313192 0.76 PTGDR2 (0.48) MAPTPTGDR2ALDH1A1CA12CA1
SCHEMBL5311262 0.76 PTGDR2 (0.47) MAPTPTGDR2ALDH1A1CA12CA1
SCHEMBL1757971 0.75 PTGDR2 (0.50) MAPTPTGDR2ALDH1A1

Similarity is cosine over the 2,048-bit Morgan fingerprint (≈ Tanimoto). Identical fingerprints score 1.00.

Patent provenance — the patents this molecule appears in, and who filed them

Claimed or disclosed in 1 patent. claimed = in the patent's claims; disclosed = body only.

PatentTitleAssigneePublishedPriorityFilingCountryStatus
WO-2007045867-A1 3 -AMINOINDOLE COMPOUNDS AS CRTH2 RECEPTOR LIGANDS ARGENTA DISCOVERY LIMITED (GB) 2007-04-26 WO disclosed